(E)-3-(3,5-dioctoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3,5-dioctoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3,5-dioctoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3,5-dioctoxy-4-(propylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3,5-dioctoxy-4-propylsulfanylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3,5-dioctoxy-4-(propylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C34H50O3S MolecularWeight: 538.824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=CC(=C1SCCC)OCCCCCCCC)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCOC1=CC(=CC(=C1SCCC)OCCCCCCCC)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C34H50O3S/c1-4-7-9-11-13-18-24-36-32-27-29(22-23-31(35)30-20-16-15-17-21-30)28-33(34(32)38-26-6-3)37-25-19-14-12-10-8-5-2/h15-17,20-23,27-28H,4-14,18-19,24-26H2,1-3H3/b23-22+